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89069-94-3,MFCD00126211
Catalog No.:AA0087BA

89069-94-3 | Benzamide, N-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0087BA
Chemical Name:
Benzamide, N-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]-
CAS Number:
89069-94-3
Molecular Formula:
C15H11F3N2OS
Molecular Weight:
324.3208
MDL Number:
MFCD00126211
SMILES:
S=C(NC(=O)c1ccccc1)Nc1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
408  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.4  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:89069-94-3 Molecular Formula|89069-94-3 MDL|89069-94-3 SMILES|89069-94-3 Benzamide, N-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]-
Catalog No.: AA0087BA
89069-94-3,MFCD00126211
89069-94-3 | Benzamide, N-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]-
Pack Size： 1mg
Purity： >90%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >90%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >90%
1 week
$358.00 $250.00
Pack Size： 500mg
Purity： >90%
1 week
$1,087.00 $761.00
Pack Size： 1g
Purity： >90%
1 week
$1,960.00 $1,372.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0087BA
Chemical Name: Benzamide, N-[thioxo[[3-(trifluoromethyl)phenyl]amino]methyl]-
CAS Number: 89069-94-3
Molecular Formula: C15H11F3N2OS
Molecular Weight: 324.3208
MDL Number: MFCD00126211
SMILES: S=C(NC(=O)c1ccccc1)Nc1cccc(c1)C(F)(F)F
Properties
Complexity: 408  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 22  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.4  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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